N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide

Systemtic Name: N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide Openeye Name: N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide CAS Name: N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide IUPAC Name: N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide Traditional Name: N-[2-(4-mesyl-2-nitro-anilino)ethyl]-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide Formula: C17H19N3O5S2 MolecularWeight: 409.47986

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)C2=CC3=C(S2)CCC3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)C2=CC3=C(S2)CCC3)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O5S2/c1-27(24,25)12-5-6-13(14(10-12)20(22)23)18-7-8-19-17(21)16-9-11-3-2-4-15(11)26-16/h5-6,9-10,18H,2-4,7-8H2,1H3,(H,19,21)